[2-oxidanylidene-2-[[2-[(phenylmethyl)carbamoyl]phenyl]amino]ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-oxidanylidene-2-[[2-[(phenylmethyl)carbamoyl]phenyl]amino]ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-[2-(benzylcarbamoyl)anilino]-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-oxo-2-[2-[oxo-[(phenylmethyl)amino]methyl]anilino]ethyl] ester IUPAC Name: [2-[2-(benzylcarbamoyl)anilino]-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-[2-(benzylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2S2/c25-19(15-28-21(27)24-12-6-7-13-24)23-18-11-5-4-10-17(18)20(26)22-14-16-8-2-1-3-9-16/h1-5,8-11H,6-7,12-15H2,(H,22,26)(H,23,25)